SCHEMBL4797458

SCHEMBL4797458

Cc1ncccc1Oc1ccc(N)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
GRM2 Q14416 2/20 0.42
MAP4K4 O95819 1/20 0.42
CYP3A4 P08684 2/20 0.41
CCR2 P41597 2/20 0.40
SYK P43405 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
CCR4 P51679 1/20 0.40
GRM4 Q14833 1/20 0.39
AR P10275 1/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPT P10636 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 2/20 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
SCHEMBL4796174 0.84 MAP4K4 (0.47) ADORA2AADORA1MAP4K4MEN1KMT2A
SCHEMBL28302902 0.84 S1PR4 (0.52) GRM2CYP3A4CCR2CYP2C9CYP2C19
SCHEMBL4799282 0.82 MAPT (0.47) ADORA2AADORA1MAP4K4ARALDH1A1
SCHEMBL21652823 0.82 ADORA2A (0.43) ADORA2AADORA1MAP4K4MEN1KMT2A
SCHEMBL4797448 0.82 GRM2 (0.42) ADORA2AADORA1GRM2MAP4K4CYP3A4
SCHEMBL4800468 0.81 CYP3A4 (0.43) CYP3A4SYKMEN1KMT2AGRM4
SCHEMBL27449031 0.80 PTGS1 (0.49) ADORA2AADORA1MAP4K4CYP3A4CCR2
SCHEMBL9447016 0.79 MEN1 (0.63) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL631806 0.79 ALDH1A1 (0.52) CYP3A4SYKMEN1KMT2AGRM4
SCHEMBL4797653 0.79 CYP3A4 (0.41) GRM2CYP3A4SYKMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7332493-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth OSI PHARMACEUTICALS (US) 2008-02-19 US claimed
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC 2005-07-21 US claimed
US-6890924-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC (US) 2005-05-10 US claimed
EP-1292591-B1 SUBSTITUTED BICYCLIC DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PROD INC (US) 2005-02-02 EP claimed
US-20020169165-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER PRODUCTS INC. 2002-11-14 US claimed
US-7332493-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth OSI PHARMACEUTICALS (US) 2008-02-19 US disclosed
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC 2005-07-21 US disclosed
US-6890924-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC (US) 2005-05-10 US disclosed
EP-1292591-B1 SUBSTITUTED BICYCLIC DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PROD INC (US) 2005-02-02 EP disclosed
US-20020169165-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER PRODUCTS INC. 2002-11-14 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 (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-20020169165-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth CCNA1, CCNT1, CCNB1 ADORA2A 2545/4885ADORA1 871/4885GRM2 3313/4885
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth CCNA1, CCNT1, CCNB1 ADORA2A 1981/4885ADORA1 352/4885GRM2 3734/4885

“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.