SCHEMBL2029639

SCHEMBL2029639

COc1nc(C)ccc1CBr

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
CD274 Q9NZQ7 9/20 0.38
PDCD1LG2 Q9BQ51 8/20 0.38
RAB9A P51151 8/20 0.36
NPC1 O15118 7/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
ATM Q13315 1/20 0.35
KDM4E B2RXH2 3/20 0.35
TP53 P04637 3/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CCR1 P32246 1/20 0.33
CCR5 P51681 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33

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
SCHEMBL16093359 0.82 APOBEC3A (0.53) APOBEC3AAPOBEC3GCD274PDCD1LG2RAB9A
SCHEMBL13171569 0.81 KDM4E (0.44) APOBEC3AAPOBEC3GCD274PDCD1LG2RAB9A
SCHEMBL5010358 0.80 CD274 (0.51) APOBEC3AAPOBEC3GCD274PDCD1LG2RAB9A
SCHEMBL2031694 0.80 KDM4E (0.47) APOBEC3AAPOBEC3GCD274PDCD1LG2RAB9A
SCHEMBL5781489 0.80 APOBEC3A (0.44) APOBEC3AAPOBEC3GCD274PDCD1LG2RAB9A
SCHEMBL29555612 0.80 KDM4E (0.47) APOBEC3AAPOBEC3GCD274PDCD1LG2RAB9A
SCHEMBL23398050 0.77 APOBEC3A (0.42) APOBEC3AAPOBEC3GCD274PDCD1LG2RAB9A
SCHEMBL23287266 0.74 MBOAT4 (0.45) CD274PDCD1LG2KDM4EHSD17B10
SCHEMBL12427065 0.73 HPGD (0.49) CD274PDCD1LG2RAB9ANPC1SMN1; SMN2
SCHEMBL1672587 0.72 RAB9A (0.41) APOBEC3AAPOBEC3GRAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11702404-B2 GLP-1R modulating compounds GILEAD SCIENCES, INC. (US) 2023-07-18 US disclosed
US-20210292333-A1 CONDENSED AZAHETEROARYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY AGAINST TUBERCULOSIS BACTERIA CADILA HEALTHCARE LIMITED (IN) 2021-09-23 US disclosed
CN-112543757-A Condensed azaheteroaryl compounds having antibacterial activity against tubercle bacillus 卡迪拉保健有限公司 2021-03-23 CN disclosed
US-8841455-B2 Substituted N-(1H-indazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide compounds as cFMS inhibitors ARRAY BIOPHARMA INC. (US) 2014-09-23 US disclosed
EP-2516433-B1 SUBSTITUTED N-(1H-INDAZOL-4-YL)IMIDAZO[1, 2-A]PYRIDINE-3- CARBOXAMIDE COMPOUNDS AS CFMS INHIBITORS ARRAY BIOPHARMA INC (US) 2014-05-21 EP disclosed
EP-2516433-A1 SUBSTITUTED N-(1H-INDAZOL-4-YL)IMIDAZO[1, 2-A]PYRIDINE-3- CARBOXAMIDE COMPOUNDS AS CFMS INHIBITORS Array Biopharma, Inc. (US) 2012-10-31 EP disclosed
US-20120258952-A1 Substituted N-(1H-Indazol-4-yl)Imidazo[1,2-a]Pyridine-3-Carboxamide Compounds as cFMS Inhibitors ARRAY BIOPHARMA INC. (US) 2012-10-11 US disclosed
WO-2011079076-A1 SUBSTITUTED N-(1H-INDAZOL-4-YL)IMIDAZO[1, 2-A]PYRIDINE-3- CARBOXAMIDE COMPOUNDS AS CFMS INHIBITORS ARRAY BIOPHARMA INC. (US) 2011-06-30 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-20210292333-A1 CONDENSED AZAHETEROARYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY AGAINST TUBERCULOSIS BACTERIA DPEP1, SAT1, PEPD APOBEC3A 4160/4885APOBEC3G 4509/4885CD274 1195/4885
US-11702404-B2 GLP-1R modulating compounds GLP1R, GIPR, GPR119 APOBEC3A 4575/4885APOBEC3G 4214/4885CD274 3049/4885
US-20120258952-A1 Substituted N-(1H-Indazol-4-yl)Imidazo[1,2-a]Pyridine-3-Carboxamide Compounds as cFMS Inhibitors AFF1, FLI1, F3 APOBEC3A 4666/4885APOBEC3G 4748/4885CD274 3602/4885

“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.