SCHEMBL18075855

SCHEMBL18075855

Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGFR P43088 11/20 0.65
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
PRNP P04156 3/20 0.63
RXFP1 Q9HBX9 3/20 0.63
TP53 P04637 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
PTGER2 P43116 1/20 0.61
PPARG P37231 2/20 0.59
NCOR2 Q9Y618 2/20 0.59
DHODH Q02127 4/20 0.53
ALDH1A1 P00352 2/20 0.52
HTT P42858 1/20 0.52
KDM4E B2RXH2 1/20 0.51
CYP1A2 P05177 1/20 0.51
HPGD P15428 1/20 0.51
CYP2C19 P33261 1/20 0.51
NR2E3 Q9Y5X4 1/20 0.49

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
SCHEMBL18089073 0.85 RXFP1 (0.65) PTGFRMEN1KMT2APRNPRXFP1
SCHEMBL4874592 0.84 PDE10A (0.65) KMT2ADHODHALDH1A1KDM4EHPGD
SCHEMBL18089186 0.82 RXFP1 (0.76) PTGFRMEN1KMT2APRNPRXFP1
SCHEMBL18075857 0.82 PTGFR (0.54) PTGFRMEN1KMT2APRNPRXFP1
SCHEMBL18089172 0.81 RXFP1 (0.74) PTGFRMEN1KMT2APRNPRXFP1
SCHEMBL18075794 0.80 PTGFR (0.84) PTGFRPTGER2
SCHEMBL14553160 0.80 DHODH (0.73) PTGFRPRNPRXFP1PPARGNCOR2
SCHEMBL18089188 0.80 PTGFR (1.00) PTGFR
Hydrochloric Acid SCHEMBL28389865 0.79 DHODH (0.71) PTGFRPRNPRXFP1PPARGNCOR2
SCHEMBL18089108 0.79 RXFP1 (0.71) PTGFRMEN1KMT2APRNPRXFP1

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-10117864-B2 Substituted N-bicyclo-2-aryl-quinolin-4-carboxamides and use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-11-06 US disclosed
US-20180036300-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-02-08 US disclosed
EP-3271334-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2018-01-24 EP disclosed
WO-2016146602-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-09-22 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-10117864-B2 Substituted N-bicyclo-2-aryl-quinolin-4-carboxamides and use thereof AADAC, BRD4, GOT2 PTGFR 1602/4885MEN1 4542/4885KMT2A 1768/4885
US-20180036300-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF AADAC, BRD4, GOT2 PTGFR 1602/4885MEN1 4542/4885KMT2A 1768/4885

“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.