SCHEMBL18923587

SCHEMBL18923587

CCC(C)c1cc(C#N)ccc1OC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.44
SLC6A4 P31645 1/20 0.40
TRPV4 Q9HBA0 1/20 0.39
CTSA P10619 2/20 0.39
KDM1A O60341 1/20 0.38
ICMT O60725 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MCL1 Q07820 1/20 0.37
ALPL P05186 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL21023399 0.88 AR (0.42) ARSLC6A4TRPV4CTSAKDM1A
SCHEMBL171796 0.87 AR (0.47) ARSLC6A4CTSAKDM1AICMT
SCHEMBL22796911 0.87 AR (0.44) ARSLC6A4TRPV4
SCHEMBL523615 0.83 AR (0.49) ARSLC6A4KDM1AICMTMEN1
SCHEMBL20855644 0.83 AR (0.43) ARSLC6A4TRPV4KDM1AMEN1
SCHEMBL20855647 0.83 AR (0.43) ARSLC6A4TRPV4KDM1AMEN1
SCHEMBL24767631 0.81 AR (0.40) ARSLC6A4TRPV4CTSAKDM1A
SCHEMBL20869018 0.80 SLC6A4 (0.43) ARSLC6A4TRPV4CTSAKDM1A
SCHEMBL20855659 0.80 AR (0.46) ARSLC6A4CTSAKDM1AMEN1
SCHEMBL20855762 0.80 AR (0.46) ARSLC6A4KDM1AICMTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10807968-B2 Substituted 2-(het)arylimidazolylcarboxyamides as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-10-20 US disclosed
US-20200048221-A1 SUBSTITUTED 2-(HET)ARYLIMIDAZOLYLCARBOXYAMIDES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-02-13 US disclosed
US-10336748-B2 Methyoxy-substituted pyrrolopyridine modulators of RORC2 and methods of use thereof PFIZER INC. (US) 2019-07-02 US disclosed
US-9670201-B2 Methyl- and trifluoromethyl-substituted pyrrolopyridine modulators of RORC2 and methods of use thereof PFIZER INC. (US) 2017-06-06 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 (3 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-20200048221-A1 SUBSTITUTED 2-(HET)ARYLIMIDAZOLYLCARBOXYAMIDES AS PESTICIDES DDT, CYP4X1, CYP4Z1 AR 3988/4885SLC6A4 3369/4885TRPV4 2051/4885
US-10807968-B2 Substituted 2-(het)arylimidazolylcarboxyamides as pesticides DDT, CYP4X1, CYP4Z1 AR 3988/4885SLC6A4 3369/4885TRPV4 2051/4885
US-10336748-B2 Methyoxy-substituted pyrrolopyridine modulators of RORC2 and methods of use thereof RORC, RORB, RORA AR 1975/4885SLC6A4 4461/4885TRPV4 724/4885

“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.