SCHEMBL23634875

SCHEMBL23634875

Cc1ccc2c(cnn2C)c1Br

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 1/20 0.34
CREBBP Q92793 2/20 0.33
TP53 P04637 2/20 0.33
PIP4K2A P48426 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDR P35968 1/20 0.32
CCR4 P51679 2/20 0.31
F7 P08709 1/20 0.31
F3 P13726 1/20 0.31
CDK2 P24941 1/20 0.31
FLT3 P36888 1/20 0.31
CCNA1 P78396 1/20 0.31

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
SCHEMBL10310477 0.80 TP53 (0.39) GRM7CREBBPTP53PIP4K2AKDR
SCHEMBL29766049 0.79 MAOB (0.36) TP53PIP4K2ANPC1RAB9AKDM4E
SCHEMBL23115842 0.79 MAOB (0.36) TP53PIP4K2ANPC1RAB9AKDM4E
SCHEMBL23302207 0.79 CCR4 (0.39) RAB9AKDM4EMEN1ALDH1A1MAPT
SCHEMBL18963841 0.79 NPC1 (0.31) NPC1RAB9A
SCHEMBL29769114 0.77 PIP4K2A (0.38) GRM7CREBBPTP53PIP4K2AKDR
SCHEMBL13676392 0.77 PIP4K2A (0.38) GRM7CREBBPTP53PIP4K2AKDR
SCHEMBL30861058 0.77 PI4KA (0.38) GRM7CREBBPTP53KDM4EALDH1A1
SCHEMBL21608562 0.77 PI4KA (0.38) GRM7CREBBPTP53KDM4EALDH1A1
SCHEMBL15518859 0.77 BRD4 (0.36) CREBBPTP53NPC1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4587014-A2 C5AR1 ANTAGONISTS AND USES THEREOF Vanqua Bio, Inc. (US) 2025-07-23 EP disclosed
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. 2024-05-30 US disclosed
WO-2024073073-A2 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2024-04-04 WO disclosed
WO-2024059096-A2 C5AR1 ANTAGONISTS AND USES THEREOF VANQUA BIO, INC. (US) 2024-03-21 WO disclosed
US-11446298-B2 Pyrimidine derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2022-09-20 US disclosed
EP-3625223-B1 PYRIMIDINE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2021-08-11 EP disclosed
EP-3848363-A1 TRICYCLIC SUBSTITUTED PIPERIDINE DIONE COMPOUND Medshine Discovery Inc. (CN) 2021-07-14 EP disclosed
US-20200108068-A1 PYRIMIDINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2020-04-09 US disclosed
CN-110621667-A Pyrimidine derivatives 爱杜西亚药品有限公司 2019-12-27 CN disclosed
EP-2855419-B1 NEW INDANYLOXYPHENYLCYCLOPROPANECARB OXYLIC ACIDS BOEHRINGER INGELHEIM INT (DE) 2017-03-01 EP disclosed
US-8633182-B2 Indanyloxyphenylcyclopropanecarboxylic acids BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-21 US disclosed
US-20130324514-A1 INDANYLOXYPHENYLCYCLOPROPANECARBOXYLIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-12-05 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 (4 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-20130324514-A1 INDANYLOXYPHENYLCYCLOPROPANECARBOXYLIC ACIDS GPR119, GPR65, INSR GRM7 1085/4885CREBBP 1292/4885TP53 4062/4885
US-11446298-B2 Pyrimidine derivatives PTGER1, PTGER4, PTGER2 GRM7 2801/4885CREBBP 393/4885TP53 713/4885
US-20200108068-A1 PYRIMIDINE DERIVATIVES PTGER1, PTGER4, PTGER2 GRM7 2801/4885CREBBP 393/4885TP53 713/4885
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF LRRK2, MAP3K20, MAP3K5 GRM7 1157/4885CREBBP 994/4885TP53 2750/4885

“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.