SCHEMBL19243458

SCHEMBL19243458

COc1ccc(C2(C(=O)O)CCC2)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.47
MEN1 O00255 4/20 0.47
TSHR P16473 1/20 0.47
ALDH1A1 P00352 2/20 0.45
AKR1C1 Q04828 1/20 0.45
NNMT P40261 1/20 0.44
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
TET3 O43151 1/20 0.39
FBXL19 Q6PCT2 1/20 0.39
CXXC5 Q7LFL8 1/20 0.39
TET1 Q8NFU7 1/20 0.39
KDM2B Q8NHM5 1/20 0.39
CXXC4 Q9H2H0 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
P2RX7 Q99572 1/20 0.39
SELP P16109 2/20 0.39
SELL P14151 1/20 0.39
EP300 Q09472 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL21874173 0.95 KMT2A (0.49) KMT2AMEN1TSHRALDH1A1AKR1C1
SCHEMBL3258917 0.94 NNMT (0.46) KMT2AMEN1TSHRALDH1A1AKR1C1
SCHEMBL21873938 0.82 ALDH1A1 (0.46) KMT2AMEN1ALDH1A1NNMTMKNK1
SCHEMBL6177725 0.80 NNMT (0.53) KMT2AMEN1ALDH1A1NNMTMKNK1
SCHEMBL29730575 0.80 NNMT (0.53) KMT2AMEN1ALDH1A1NNMTMKNK1
SCHEMBL3007679 0.80 AKR1C1 (0.44) KMT2AMEN1TSHRALDH1A1AKR1C1
SCHEMBL12850050 0.78 NNMT (0.39) KMT2AMEN1ALDH1A1NNMTMKNK1
SCHEMBL21964347 0.78 HSD11B1 (0.56) KMT2AMEN1TSHRALDH1A1EP300
SCHEMBL23231746 0.78 NNMT (0.41) KMT2AMEN1ALDH1A1NNMTMKNK1
SCHEMBL21874594 0.76 AKR1C1 (0.49) KMT2AMEN1TSHRALDH1A1AKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230338373-A1 INHIBITOR OF INDOLEAMINE-2,3-DIOXYGENASE (IDO) INVENTISBIO LLC 2023-10-26 US disclosed
US-20230027952-A1 NOVEL SALTS OF INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS InventisBio Co., Ltd. (CN) 2023-01-26 US disclosed
US-20220054486-A1 INHIBITOR OF INDOLEAMINE-2,3-DIOXYGENASE (IDO) INVENTISBIO LLC (US) 2022-02-24 US disclosed
WO-2021104186-A1 NOVEL SALTS OF INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS InventisBio Co., Ltd. (CN) 2021-06-03 WO disclosed
WO-2017139414-A1 INHIBITOR OF INDOLEAMINE-2,3-DIOXYGENASE (IDO) INVENTISBIO INC. (KY) 2017-08-17 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 (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-20230338373-A1 INHIBITOR OF INDOLEAMINE-2,3-DIOXYGENASE (IDO) IDO1, IDO2, INMT KMT2A 506/4885MEN1 1500/4885TSHR 3848/4885
US-20230027952-A1 NOVEL SALTS OF INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS IDO1, IDO2, KYNU KMT2A 1577/4885MEN1 1721/4885TSHR 2886/4885
US-20220054486-A1 INHIBITOR OF INDOLEAMINE-2,3-DIOXYGENASE (IDO) IDO1, IDO2, INMT KMT2A 506/4885MEN1 1500/4885TSHR 3848/4885

“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.