SCHEMBL15071103

SCHEMBL15071103

Cc1c(-c2ccccc2)nc2ccc(C(=O)N3CCCCC3)cn12

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ F2RL1 P55085 1/20 0.56
▸ HPGD P15428 9/20 0.55
▸ MAPK1 P28482 1/20 0.51
▸ CNR1 P21554 1/20 0.49
▸ SLC2A1 P11166 2/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ KMT2A Q03164 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPT P10636 1/20 0.45
▸ GABRA5 P31644 1/20 0.45
▸ AKT1 P31749 1/20 0.44
▸ AKT2 P31751 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ LMNA P02545 1/20 0.44

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
SCHEMBL15071097 0.86 HPGD (0.55) F2RL1HPGDMAPK1CNR1NPC1
SCHEMBL15071100 0.83 F2RL1 (0.77) F2RL1HPGDMAPK1CNR1NPC1
SCHEMBL15071143 0.81 F2RL1 (0.74) F2RL1HPGDMAPK1CNR1SLC2A1
SCHEMBL21500651 0.80 AKT1 (0.56) HPGDNPC1RAB9ATSHRALDH1A1
SCHEMBL2127536 0.78 AKT1 (0.58) HPGDNPC1RAB9ATSHRALDH1A1
SCHEMBL15050221 0.76 F2RL1 (0.53) F2RL1HPGDNPC1RAB9ATSHR
SCHEMBL5337926 0.75 CNR1 (0.58) F2RL1HPGDCNR1SLC2A1KMT2A
SCHEMBL5322233 0.75 CNR1 (0.58) F2RL1HPGDCNR1SLC2A1KMT2A
SCHEMBL15071099 0.75 F2RL1 (0.52) F2RL1HPGDNPC1RAB9ATSHR
SCHEMBL31560 0.75 F2RL1 (0.63) F2RL1HPGDMAPK1NPC1RAB9A

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
EP-2617721-A2 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME Neopharm Co., Ltd. (KR) 2013-07-24 — — EP disclosed
US-20130165652-A1 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME NEOPHARM CO.,LTD. (KR) 2013-06-27 — — US disclosed
US-20130165652-A1 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME NEOPHARM CO.,LTD. (KR) 2013-06-27 — — 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 (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-20130165652-A1 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME F2RL1, F2R, FPR2 F2RL1 1/4885HPGD 80/4885MAPK1 1566/4885

“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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