SCHEMBL17912658

SCHEMBL17912658

O=C(O)c1ccc(-c2cc(C(=O)c3c(Cl)cccc3Cl)n3cc(C(=O)O)cnc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 15/20 0.48
▸ CYP2C9 P11712 3/20 0.43
▸ CDK4 P11802 2/20 0.42
▸ CDK2 P24941 2/20 0.42
▸ EGLN1 Q9GZT9 1/20 0.41
▸ MAP4K4 O95819 1/20 0.41
▸ PPARG P37231 1/20 0.41
▸ CCNB2 O95067 1/20 0.40
▸ CCNE2 O96020 1/20 0.40
▸ CDK1 P06493 1/20 0.40
▸ CCNB1 P14635 1/20 0.40
▸ CCND1 P24385 1/20 0.40
▸ CCNE1 P24864 1/20 0.40
▸ CCNB3 Q8WWL7 1/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ RARG P13631 1/20 0.40
▸ SRD5A2 P31213 1/20 0.40

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
SCHEMBL17912757 0.84 RORC (0.65) RORCCYP2C9PPARGRARG
SCHEMBL17912699 0.78 RORC (0.46) RORCCYP2C9CDK4CDK2CYP3A4
SCHEMBL17912592 0.76 RORC (0.55) RORCCYP2C9PPARGCYP3A4CYP1A2
SCHEMBL17912628 0.76 RORC (0.63) RORCCYP2C9PPARGCYP3A4CYP1A2
SCHEMBL17912684 0.76 RORC (0.48) RORCCYP2C9CDK4CDK2PPARG
SCHEMBL17912599 0.76 RORC (0.54) RORCCYP2C9CDK4CDK2CYP3A4
SCHEMBL17912672 0.76 RORC (0.55) RORCCYP2C9CYP3A4CYP1A2CYP2C19
SCHEMBL17912730 0.76 RORC (0.43) RORCCYP2C9CDK4CDK2PPARG
SCHEMBL17912559 0.74 RORC (0.56) RORCCYP2C9PPARGCYP3A4CYP1A2
SCHEMBL17912571 0.74 RORC (0.58) RORCCYP2C9CYP3A4CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3242878-B1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF IMPETIS BIOSCIENCES LTD (IN) 2020-10-14 — — EP claimed
US-20170362225-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF IMPETIS BIOSCIENCES LTD. (IN) 2017-12-21 — — US claimed
EP-3242878-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF Advinus Therapeutics Limited (IN) 2017-11-15 — — EP claimed
WO-2016110821-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF ADVINUS THERAPEUTICS LIMITED (IN) 2016-07-14 — — WO claimed
EP-3242878-B1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF IMPETIS BIOSCIENCES LTD (IN) 2020-10-14 — — EP disclosed
US-10435402-B2 Bicyclic compounds, compositions and medicinal applications thereof ADVINUS THERAPEUTICS LIMITED (IN) 2019-10-08 — — US disclosed
US-20170362225-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF IMPETIS BIOSCIENCES LTD. (IN) 2017-12-21 — — US disclosed
EP-3242878-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF Advinus Therapeutics Limited (IN) 2017-11-15 — — EP disclosed
WO-2016110821-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF ADVINUS THERAPEUTICS LIMITED (IN) 2016-07-14 — — WO 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-20170362225-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF RORC, RORA, RORB RORC 1/4885CYP2C9 298/4885CDK4 876/4885
US-10435402-B2 Bicyclic compounds, compositions and medicinal applications thereof RORA, RORB, RORC RORC 3/4885CYP2C9 199/4885CDK4 1579/4885

“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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