SCHEMBL4032281

SCHEMBL4032281

c1ccc(-c2ccncc2)c(-c2ccncc2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.63
MAPT P10636 4/20 0.59
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.53
ALDH1A1 P00352 2/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
HSD17B10 Q99714 2/20 0.50
IMPDH2 P12268 1/20 0.50
MAPK1 P28482 1/20 0.50
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
TP53 P04637 2/20 0.48
MAPK10 P53779 2/20 0.48
PIK3CD O00329 1/20 0.48
AURKA O14965 1/20 0.48
CDK1 P06493 1/20 0.48
LYN P07948 1/20 0.48
PIM1 P11309 1/20 0.48
FGFR1 P11362 1/20 0.48

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
SCHEMBL30708901 1.00 NOTUM (0.63) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL1947212 0.97 NOTUM (0.60) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL12853983 0.97 NOTUM (0.60) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
Bromide SCHEMBL20502184 0.94 NOTUM (0.57) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL11217649 0.94 NOTUM (0.74) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
Ethylene SCHEMBL28740135 0.89 NOTUM (0.67) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
Ethylene SCHEMBL28518460 0.89 NOTUM (0.67) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
Ethylene SCHEMBL28507054 0.89 NOTUM (0.67) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL9958487 0.85 NOTUM (0.48) NOTUMMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL1424250 0.85 RPS6KA3 (0.63) NOTUMMAPTLMNASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119463170-A Preparation method and application of triazinyl ionic organic polymer 昆明理工大学 2025-02-18 CN claimed
WO-2009098001-A1 ORGANOMETALLIC SKELETON COMPOUNDS ON THE BASIS OF TRIPTYCENE BAYER MATERIALSCIENCE AG (DE) 2009-08-13 WO claimed
CN-116589726-B Preparation method of composite membrane sensor for detecting tyrosine 中北大学 2023-09-22 CN disclosed
CN-116589726-A Preparation method of composite membrane sensor for detecting tyrosine 中北大学 2023-08-15 CN disclosed
CN-107922830-B Electrochromic compounds and optical articles containing them 依视路国际公司 2021-08-20 CN disclosed
WO-2009098001-A1 ORGANOMETALLIC SKELETON COMPOUNDS ON THE BASIS OF TRIPTYCENE BAYER MATERIALSCIENCE AG (DE) 2009-08-13 WO disclosed