SCHEMBL873431

SCHEMBL873431

Cc1ccc2nccc(C)c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.58
ADRA1D P25100 3/20 0.58
ADRA1A P35348 3/20 0.58
ADRA1B P35368 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.54
ALDH1A1 P00352 3/20 0.48
PARP1 P09874 1/20 0.47
CCR1 P32246 2/20 0.46
CCR5 P51681 2/20 0.46
CCR8 P51685 2/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
HCRTR1 O43613 1/20 0.46
USP2 O75604 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
CASP3 P42574 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL29847401 1.00 HTR1A (0.58) HTR1AADRA1DADRA1AADRA1BSMN1; SMN2
SCHEMBL873159 0.83 HTR1A (0.58) HTR1AADRA1DADRA1AADRA1BSMN1; SMN2
SCHEMBL741042 0.79 SLC22A12 (0.53) SMN1; SMN2ALDH1A1CCR1CCR5CCR8
SCHEMBL827782 0.79 NR4A2 (0.61) SMN1; SMN2ALDH1A1PARP1CCR1CCR5
SCHEMBL5539375 0.79 HTR1A (0.54) HTR1AADRA1DADRA1AADRA1BSMN1; SMN2
SCHEMBL16289832 0.79 HTR1A (0.54) HTR1AADRA1DADRA1AADRA1BSMN1; SMN2
SCHEMBL4758609 0.79 LMNA (0.56) HTR1AADRA1DADRA1AADRA1BSMN1; SMN2
SCHEMBL4644505 0.79 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1PARP1CCR1CCR5
SCHEMBL22277957 0.79 SMN1; SMN2 (0.51) HTR1AADRA1DADRA1AADRA1BSMN1; SMN2
SCHEMBL18544878 0.79 HTR1A (0.54) HTR1AADRA1DADRA1AADRA1BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113176253-B Occult blood indicator for animal excrement and application thereof 上海麦可信生物科技有限公司 2023-05-23 CN claimed
CN-110437143-B Benzyl substituted quinoline and derivative and synthesis method thereof 湘潭大学 2022-08-09 CN claimed
CN-113176253-A Animal excrement occult blood indicator and application thereof 上海麦可信生物科技有限公司 2021-07-27 CN claimed
CN-109776406-B Method for cross coupling of ether compound and quinoline derivative 湘潭大学 2021-05-04 CN claimed
CN-110272383-A 2- is alkylated 4- methylquinoline, derivative and its synthetic method 湘潭大学 2019-09-24 CN claimed
US-9796800-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2017-10-24 US claimed
US-20160108153-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORPORATION (JP) 2016-04-21 US claimed
CN-103154044-B Process for producing polydienes BRIDGESTONE CO.,LTD. (JP) 2016-02-17 CN claimed
US-9249244-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2016-02-02 US claimed
EP-2619233-A1 PROCESS FOR PRODUCING POLYDIENES Bridgestone Corporation (JP) 2013-07-31 EP claimed
CN-103154044-A Process for producing polydienes BRIDGESTONE CORP 2013-06-12 CN claimed
WO-2012040026-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORPORATION (JP) 2012-03-29 WO claimed
US-7692016-B2 Process for the synthesis of quinoline derivatives COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2010-04-06 US claimed
WO-2007060685-A1 AN IMPROVED PROCESS FOR THE SYNTHESIS OF QUINOLINE DERIVATIVES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2007-05-31 WO claimed
US-20070123708-A1 Process for the synthesis of quinoline derivatives COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-05-31 US claimed
EP-0039205-B1 SELECTIVE PRODUCTION OF DIALKYLBENZENES MOBIL OIL CORPORATION (US) 1985-01-30 EP claimed
US-3986833-A TEST COMPOSITION, DEVICE, AND METHOD FOR THE DETECTION OF PEROXIDATIVELY ACTIVE SUBSTANCES MILES LABORATORIES, INC. (US) 1976-10-19 US claimed
US-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 US disclosed
US-4108668-A Light-sensitive silver halide photographic materials KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1978-08-22 US disclosed
US-3986833-A TEST COMPOSITION, DEVICE, AND METHOD FOR THE DETECTION OF PEROXIDATIVELY ACTIVE SUBSTANCES MILES LABORATORIES, INC. (US) 1976-10-19 US 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 (2 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-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 KLK5, KLK1, KLKB1 HTR1A 3824/4885ADRA1D 3274/4885ADRA1A 3776/4885
US-20070123708-A1 Process for the synthesis of quinoline derivatives NDUFS4, NDUFS3, NDUFS5 HTR1A 2093/4885ADRA1D 3048/4885ADRA1A 2670/4885

“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.