SCHEMBL2491633

SCHEMBL2491633

c1ccc(N(c2ccccc2)c2onc3ccccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.35
DCPS Q96C86 1/20 0.34
ALDH1A1 P00352 6/20 0.34
HPGD P15428 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TDP1 Q9NUW8 3/20 0.33
KDM4E B2RXH2 3/20 0.33
MAOA P21397 2/20 0.33
PDE5A O76074 2/20 0.33
CYP1A2 P05177 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GLA P06280 1/20 0.33
CHRM2 P08172 1/20 0.33
ADRA2A P08913 1/20 0.33

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
SCHEMBL2494366 0.76 CYP1A2 (0.43) EGFRALDH1A1HPGDSMN1; SMN2TDP1
SCHEMBL31001160 0.68 ALDH1A1 (0.46) ALDH1A1HPGDSMN1; SMN2TDP1KDM4E
SCHEMBL16483993 0.67 ALDH1A1 (0.48) ALDH1A1HPGDSMN1; SMN2TDP1KDM4E
Triphenylene SCHEMBL28455198 0.66 ALDH1A1 (0.57) ALDH1A1HPGDTDP1KDM4ECYP1A2
SCHEMBL2492556 0.65 ALDH1A1 (0.62) ALDH1A1HPGDSMN1; SMN2KDM4EHSD17B10
SCHEMBL31301216 0.65 KDM1A (0.50) EGFRALDH1A1SMN1; SMN2TDP1KDM4E
Phenazine SCHEMBL28092427 0.65 MAPT (0.61) ALDH1A1HPGDSMN1; SMN2TDP1KDM4E
SCHEMBL5276597 0.64 GPR3 (0.40) ALDH1A1HPGDSMN1; SMN2TDP1KDM4E
SCHEMBL3816281 0.64 GPR3 (0.40) ALDH1A1HPGDSMN1; SMN2TDP1KDM4E
SCHEMBL1423001 0.64 GPR3 (0.46) ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030438-B2 Thiophene compound having phosphoric ester and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-10-04 US disclosed
US-20100019229-A1 Thiophene compound having phosphoric ester and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2010-01-28 US disclosed
EP-1882694-A1 THIOPHENE COMPOUND HAVING PHOSPHORIC ESTER AND PROCESS FOR PRODUCING THE SAME Nissan Chemical Industries, Ltd. (JP) 2008-01-30 EP 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 (1 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-20100019229-A1 Thiophene compound having phosphoric ester and process for producing the same RRP12, NR2E1, TST EGFR 2552/4885DCPS 190/4885ALDH1A1 4083/4885

“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.