SCHEMBL4084096

SCHEMBL4084096

Nc1cccc2cc(F)ccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
CYP3A4 P08684 3/20 0.54
HPGD P15428 3/20 0.54
HSD17B10 Q99714 3/20 0.54
TSHR P16473 2/20 0.54
KEAP1 Q14145 1/20 0.54
CYP1A2 P05177 2/20 0.48
CYP2A6 P11509 1/20 0.48
TDP1 Q9NUW8 2/20 0.44
LMNA P02545 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2D6 P10635 1/20 0.44
KDM4E B2RXH2 3/20 0.42
POLB P06746 2/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 2/20 0.42
RCE1 Q9Y256 2/20 0.42
NPC1 O15118 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL30369928 1.00 ALDH1A1 (0.54) ALDH1A1CYP3A4HPGDHSD17B10TSHR
SCHEMBL4077565 0.83 ALDH1A1 (0.54) ALDH1A1CYP3A4HPGDHSD17B10TSHR
Hydrochloric Acid SCHEMBL7416083 0.81 ALDH1A1 (0.52) ALDH1A1CYP3A4HPGDHSD17B10TSHR
SCHEMBL29498391 0.77 PLAU (0.63) ALDH1A1CYP3A4HPGDHSD17B10TSHR
SCHEMBL30366550 0.77 CYP1A2 (0.52) ALDH1A1CYP1A2CYP2A6HPRT1IDO1
SCHEMBL29404930 0.77 PLAU (0.63) ALDH1A1CYP3A4HPGDHSD17B10TSHR
SCHEMBL30366173 0.77 CYP1A2 (0.52) ALDH1A1CYP1A2CYP2A6HPRT1IDO1
SCHEMBL5748246 0.77 CYP1A2 (0.52) ALDH1A1CYP1A2CYP2A6HPRT1IDO1
SCHEMBL18530961 0.77 CYP1A2 (0.52) ALDH1A1HPGDHSD17B10TSHRCYP1A2
SCHEMBL5383334 0.77 HPRT1 (0.54) ALDH1A1CYP3A4HPGDHSD17B10TSHR

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 86 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250368641-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORP (US) 2025-12-04 US disclosed
US-12378243-B2 Quinoline compounds as inhibitors of KRAS INCYTE CORPORATION (US) 2025-08-05 US disclosed
US-20250188073-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORP (US) 2025-06-12 US disclosed
EP-4548918-A2 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2025-05-07 EP disclosed
US-20240368152-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORPORATION 2024-11-07 US disclosed
EP-4415824-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2024-08-21 EP disclosed
CN-118525017-A Quinoline compounds as KRAS inhibitors 因赛特公司 2024-08-20 CN disclosed
US-12030883-B2 Hetero-tricyclic compounds as inhibitors of KRAS INCYTE CORPORATION (US) 2024-07-09 US disclosed
US-12030883-B2 Hetero-tricyclic compounds as inhibitors of KRAS INCYTE CORPORATION (US) 2024-07-09 US disclosed
EP-4393915-A1 ISOINDOLINONE COMPOUND AND USE THEREOF Hangzhou Glubio Pharmaceutical Co. Ltd. (CN) 2024-07-03 EP disclosed
EP-0985414-A2 Method of treating glaucoma and ischemic retinopathy Pfizer Products Inc. (US) 2000-03-15 EP disclosed
EP-0931547-A1 Piperazinyl-heterocyclic compounds in the treatment of psychiatric conditions Pfizer Products Inc. (US) 1999-07-28 EP disclosed
EP-0901789-A1 Method of treating tourette's syndrome Pfizer Products Inc. (US) 1999-03-17 EP disclosed
EP-0279598-B1 ARYLPIPERAZINYL-ALKYLENE-PHENYL-HETEROCYCLIC COMPOUNDS PFIZER INC. (US) 1993-09-15 EP disclosed
EP-0281309-B1 PIPERAZINYL-HETEROCYCLIC COMPOUNDS PFIZER INC. (US) 1991-12-27 EP disclosed
US-4891375-A Arylpiperazinyl-alkylene-phenyl-heterocyclic compounds PFIZER INC. (US) 1990-01-02 US disclosed
US-4883795-A Piperazinyl-heterocyclic compounds PFIZER INC. (US) 1989-11-28 US disclosed
US-4831031-A Aryl piperazinyl-(C2 or C4) alkylene heterocyclic compounds having neuroleptic activity PFIZER INC. (US) 1989-05-16 US disclosed
EP-0281309-A1 Piperazinyl-heterocyclic compounds PFIZER INC. (US) 1988-09-07 EP disclosed
EP-0279598-A2 Arylpiperazinyl-alkylene-phenyl-heterocyclic compounds PFIZER INC. (US) 1988-08-24 EP 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 (5 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-12030883-B2 Hetero-tricyclic compounds as inhibitors of KRAS KRAS, NRAS, HRAS ALDH1A1 3337/4885CYP3A4 3951/4885HPGD 1090/4885
US-12378243-B2 Quinoline compounds as inhibitors of KRAS KRAS, NRAS, HRAS ALDH1A1 1858/4885CYP3A4 3762/4885HPGD 647/4885
US-20240368152-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS KRAS, NRAS, HRAS ALDH1A1 1858/4885CYP3A4 3762/4885HPGD 647/4885
US-20250188073-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS KRAS, NRAS, HRAS ALDH1A1 2204/4885CYP3A4 3923/4885HPGD 799/4885
US-20250368641-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS KRAS, NRAS, HRAS ALDH1A1 1858/4885CYP3A4 3762/4885HPGD 647/4885

“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.