SCHEMBL6904472

SCHEMBL6904472

C[C@H]([C]=O)Nc1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 4/20 0.44
CYP3A4 P08684 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
HIF1A Q16665 2/20 0.44
HPGD P15428 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 4/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 4/20 0.41

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
SCHEMBL1713201 1.00 RAB9A (0.47) RAB9ASMN1; SMN2GAAALDH1A1CYP3A4
SCHEMBL1713200 1.00 RAB9A (0.47) RAB9ASMN1; SMN2GAAALDH1A1CYP3A4
SCHEMBL9359370 0.79 TDP1 (0.54) RAB9ASMN1; SMN2GAAALDH1A1CYP3A4
SCHEMBL7213152 0.77 TDP1 (0.56) GAAALDH1A1CYP3A4HSD17B10HIF1A
SCHEMBL946382 0.77 TDP1 (0.56) GAAALDH1A1CYP3A4HSD17B10HIF1A
SCHEMBL8943046 0.76 KDM4E (0.50) RAB9ASMN1; SMN2ALDH1A1HSD17B10CYP1A2
SCHEMBL8943054 0.76 KDM4E (0.50) RAB9ASMN1; SMN2ALDH1A1HSD17B10CYP1A2
SCHEMBL10401390 0.76 UGT2B7 (0.52) RAB9ASMN1; SMN2GAAALDH1A1CYP3A4
SCHEMBL25664541 0.75 RAB9A (0.47) RAB9ASMN1; SMN2GAAALDH1A1CYP3A4
SCHEMBL43518 0.74 RAB9A (0.54) RAB9ASMN1; SMN2GAAALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010009899-A1 Process for the preparation of pharmaceutical compositions possessing neurogenic or non-neurogenic anti-inflammatory as well as analgetic effects KERI GYORGY (HU) 2001-07-26 US claimed
EP-0952159-A2 Use of somatostatin derivatives and/or of phenylhydrazone derivatives as antinflammatory or analgetic agents Biostatin Gyogyszerkutato-Fejleszto Kft. (HU) 1999-10-27 EP claimed
EP-0400065-A4 LHRH ANALOGS 1991-03-13 EP claimed
EP-0413209-A1 LHRH analogs TAP Pharmaceuticals Inc. (US) 1991-02-20 EP claimed
EP-0400065-A1 LHRH ANALOGS. ABBOTT LAB (US) 1990-12-05 EP claimed
WO-1989007450-A1 LHRH ANALOGS ABBOTT LABORATORIES (US) 1989-08-24 WO claimed
EP-0328090-A2 LHRH analogs ABBOTT LABORATORIES (US) 1989-08-16 EP claimed
US-6689813-B2 SOMATOSTATIN DERIVATIVES AND PEPTIDOMIMETICS; TREATMENT OF RHINITIS, BRONCHITIS, BRONCHIAL ASTHMA, ARTHRITIS; CONJUNCTIVITIS, COLITIS, PSORIASIS BIOSTATIN GYOGYSZERKUTATO-FEJLESZTO KFT. (HU) 2004-02-10 US disclosed
US-20010009899-A1 Process for the preparation of pharmaceutical compositions possessing neurogenic or non-neurogenic anti-inflammatory as well as analgetic effects KERI GYORGY (HU) 2001-07-26 US disclosed
EP-0952159-A2 Use of somatostatin derivatives and/or of phenylhydrazone derivatives as antinflammatory or analgetic agents Biostatin Gyogyszerkutato-Fejleszto Kft. (HU) 1999-10-27 EP disclosed
US-5595985-A Combination therapy for prophylaxis and/or treatment of benign prostatic hyperplasia ENDORECHERCHE INC. (CA) 1997-01-21 US disclosed
US-5480870-A HEPTAPEPTIDE AND OCTAPEPTIDE AMIDE DERIVATIVES; TREATMENT OF EXCESSIVE SECRETION OF INSULIN, GLUCAGON OR GROWTH HORMONE BIOSIGNAL KUTATO-FEJLESZTOKFT (HU) 1996-01-02 US disclosed
EP-0505680-B1 Octapeptide or heptapeptide derivatives, a process for preparing them as well as medicaments containing these compounds and the use of them BIOSIGNAL KUTATO FEJLESZTOE (HU) 1995-04-26 EP disclosed
EP-0505680-A1 Octapeptide or heptapeptide derivatives, a process for preparing them as well as medicaments containing these compounds and the use of them BIOSIGNAL Kutato-Fejleszto Kft. (HU) 1992-09-30 EP disclosed
WO-1983002272-A1 SYNTHETIC PEPTIDES HAVING PITUITARY GROWTH HORMONE RELEASING ACTIVITY BECKMAN INSTRUMENTS INC (US) 1983-07-07 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 (1 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-20010009899-A1 Process for the preparation of pharmaceutical compositions possessing neurogenic or non-neurogenic anti-inflammatory as well as analgetic effects VIP, NOS3, NPR3 RAB9A 3631/4885SMN1; SMN2 1139/4885GAA 2674/4885

“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.