SCHEMBL11840447

SCHEMBL11840447

Nc1ccccc1C(=O)OC(=O)c1ccccc1NC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 11/20 0.54
▸ HSD17B10 Q99714 10/20 0.54
▸ CFTR P13569 1/20 0.54
▸ KDM4E B2RXH2 6/20 0.49
▸ NPC1 O15118 4/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ CASP3 P42574 1/20 0.49
▸ SENP8 Q96LD8 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ SENP6 Q9GZR1 1/20 0.49
▸ HPGD P15428 4/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ MAPK1 P28482 3/20 0.45
▸ TSHR P16473 3/20 0.45
▸ GLA P06280 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL11840460 0.90 KMT2A (0.53) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2
SCHEMBL27589476 0.83 ALDH1A1 (0.49) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2
SCHEMBL27613249 0.83 MAPT (0.64) ALDH1A1HSD17B10CFTRKDM4EHPGD
SCHEMBL2367627 0.82 ALDH1A1 (0.69) ALDH1A1HSD17B10CFTRKDM4ENPC1
SCHEMBL27422765 0.80 ALDH1A1 (0.67) ALDH1A1HSD17B10CFTRKDM4ENPC1
SCHEMBL27559645 0.80 KMT2A (0.51) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2
SCHEMBL4956879 0.78 NPC1 (0.69) ALDH1A1HSD17B10KDM4ENPC1RAB9A
SCHEMBL12811737 0.78 KMT2A (0.71) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2
SCHEMBL10743516 0.78 MAPT (0.60) ALDH1A1HSD17B10CFTRKDM4ENPC1
SCHEMBL27422766 0.78 ALDH1A1 (0.58) ALDH1A1HSD17B10CFTRKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3984556-A Alkyl-substituted-tricyclic quinazolinones for lowering blood pressure SANDOZ, INC. (US) 1976-10-05 — — US disclosed
US-3982000-A Alkyl-substituted-tricyclic quinazolinones as bronchodilators SANDOZ, INC. (US) 1976-09-21 — — US disclosed
US-3978059-A BRONCHODILATOR AGENTS SANDOZ, INC. (US) 1976-08-31 — — US disclosed
US-3969506-A BRONCHODILATOR SANDOZ, INC. (US) 1976-07-13 — — US disclosed
US-3912731-A N-substituted anthranilic anhydrides SANDOZ AG 1975-10-14 — — US disclosed
US-3905976-A Substituted tricyclic quinazolinones SANDOZ AG 1975-09-16 — — US disclosed
US-3887559-A Pharmacologically active tricyclic quinazolinones SANDOZ AG 1975-06-03 — — US disclosed
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