SCHEMBL29184235

SCHEMBL29184235

COc1ccc(CCNI)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ HTT P42858 1/20 0.56
▸ MAPT P10636 1/20 0.56
▸ CA12 O43570 1/20 0.56
▸ CA1 P00915 1/20 0.56
▸ CA2 P00918 1/20 0.56
▸ CA5A P35218 1/20 0.56
▸ CA9 Q16790 1/20 0.56
▸ CA14 Q9ULX7 1/20 0.56
▸ TAAR1 Q96RJ0 1/20 0.55
▸ LMNA P02545 2/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ ADRB2 P07550 2/20 0.53
▸ F2RL1 P55085 1/20 0.52
▸ GLA P06280 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ CALM1 P0DP23 1/20 0.50

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
SCHEMBL681498 0.81 CHRM2 (0.61) SMN1; SMN2HTTMAPTCA12CA1
SCHEMBL834551 0.79 TAAR1 (0.73) CA12CA1CA2CA9CA14
SCHEMBL7528515 0.79 SMN1; SMN2 (0.58) SMN1; SMN2HTTMAPTCA12CA1
SCHEMBL18065436 0.79 TAAR1 (0.61) SMN1; SMN2HTTMAPTCA12CA1
Hydrochloric Acid SCHEMBL1029558 0.79 CHRM2 (0.59) SMN1; SMN2HTTMAPTCA12CA1
SCHEMBL6896486 0.79 SMN1; SMN2 (0.58) SMN1; SMN2HTTMAPTCA12CA1
SCHEMBL23590401 0.79 SMN1; SMN2 (0.62) SMN1; SMN2HTTMAPTCA12CA1
SCHEMBL14441697 0.78 ALDH1A1 (0.57) HTTMAPTCA12CA1CA2
SCHEMBL178692 0.78 TAAR1 (0.64) CA12CA1CA2CA9CA14
SCHEMBL6687730 0.78 MAPT (0.86) SMN1; SMN2HTTMAPTCA12CA1

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
CN-117835712-A Poly (triarylamine) composite layer and application thereof in perovskite solar cell 华北电力大学 2024-04-05 — — CN claimed
CN-117835713-A Hole transport layer without air oxidation and capable of protecting perovskite and application thereof 华北电力大学 2024-04-05 — — CN claimed
CN-118488770-A Method for preparing perovskite film and solar cell in air environment 华北电力大学 2024-08-13 — — CN disclosed
CN-117835712-A Poly (triarylamine) composite layer and application thereof in perovskite solar cell 华北电力大学 2024-04-05 — — CN disclosed
CN-117835713-A Hole transport layer without air oxidation and capable of protecting perovskite and application thereof 华北电力大学 2024-04-05 — — CN disclosed
Send feedback