SCHEMBL10035782

SCHEMBL10035782

Cc1ccc(/C=C/c2ccc(-c3cccs3)s2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.53
▸ ALDH1A1 P00352 5/20 0.52
▸ HPGD P15428 4/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ NPSR1 Q6W5P4 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ CYP1A2 P05177 2/20 0.52
▸ CYP2D6 P10635 2/20 0.52
▸ CYP2C9 P11712 2/20 0.52
▸ CYP2C19 P33261 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ CASP3 P42574 1/20 0.52
▸ SENP8 Q96LD8 1/20 0.52
▸ SENP7 Q9BQF6 1/20 0.52
▸ SENP6 Q9GZR1 1/20 0.52
▸ GLA P06280 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13978511 0.92 DPP4 (0.61) DPP4ALDH1A1HPGDKDM4ENPSR1
SCHEMBL14156061 0.87 NFE2L2 (0.48) ALDH1A1HPGDKDM4ENPSR1SMN1; SMN2
SCHEMBL14156064 0.85 NFE2L2 (0.47) ALDH1A1HPGDKDM4ENPSR1SMN1; SMN2
SCHEMBL30375911 0.85 DPP4 (0.69) DPP4ALDH1A1HPGDKDM4ENPSR1
SCHEMBL19721713 0.85 DPP4 (0.69) DPP4ALDH1A1HPGDKDM4ENPSR1
SCHEMBL19076188 0.84 CYP1A2 (0.49) DPP4ALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL20371369 0.82 DPP4 (0.57) DPP4ALDH1A1HPGDKDM4ENPSR1
SCHEMBL13480642 0.78 NFE2L2 (0.44) KDM4ECYP1A2CYP2C9MAPTCYP3A4
SCHEMBL769251 0.78 DPP4 (0.61) DPP4ALDH1A1HPGDKDM4ENPSR1
SCHEMBL8575384 0.78 DPP4 (0.61) DPP4ALDH1A1HPGDKDM4ENPSR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8102113-B2 Quinoxaline-containing compounds and polymers thereof FUJI XEROX CO., LTD. (JP) 2012-01-24 — — US disclosed
US-8102113-B2 Quinoxaline-containing compounds and polymers thereof FUJI XEROX CO., LTD. (JP) 2012-01-24 — — US disclosed
US-7910748-B2 Thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2011-03-22 — — US disclosed
US-7910748-B2 Thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2011-03-22 — — US disclosed
US-7902382-B2 Thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2011-03-08 — — US disclosed
US-7902382-B2 Thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2011-03-08 — — US disclosed
US-20100133995-A1 Novel thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2010-06-03 — — US disclosed
US-20100133995-A1 Novel thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2010-06-03 — — US disclosed
US-20100137553-A1 Novel thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2010-06-03 — — US disclosed
US-20100137553-A1 Novel thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2010-06-03 — — US disclosed
US-7659410-B2 Thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2010-02-09 — — US disclosed
US-7659410-B2 Thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2010-02-09 — — US disclosed
US-20080306239-A1 QUINOXALINE-CONTAINING COMPOUNDS AND POLYMERS THEREOF FUJI XEROX CO., LTD. (JP) 2008-12-11 — — US disclosed
US-20080306239-A1 QUINOXALINE-CONTAINING COMPOUNDS AND POLYMERS THEREOF FUJI XEROX CO., LTD. (JP) 2008-12-11 — — US disclosed
US-20070252519-A1 Novel thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2007-11-01 — — US disclosed
US-20070252519-A1 Novel thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium FUJI XEROX CO., LTD. (JP) 2007-11-01 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080306239-A1 QUINOXALINE-CONTAINING COMPOUNDS AND POLYMERS THEREOF ARL1, NMRAL1, PDXK DPP4 4514/4885ALDH1A1 1275/4885HPGD 2772/4885
US-20070252519-A1 Novel thiophene-containing compound and thiophene-containing compound polymer, organic electroluminescent device, production method thereof, and image display medium ARL1, NOD1, NLRP1 DPP4 4713/4885ALDH1A1 1283/4885HPGD 4758/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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