SCHEMBL3790481

SCHEMBL3790481

CCCc1ccc(N)c(Cl)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.63
▸ SKP2 Q13309 1/20 0.48
▸ TSHR P16473 3/20 0.46
▸ PNMT P11086 1/20 0.45
▸ TAAR1 Q96RJ0 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ CNR1 P21554 1/20 0.44
▸ CNR2 P34972 1/20 0.44
▸ GLA P06280 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ SIGMAR1 Q99720 4/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ CSNK2A1 P68400 2/20 0.40
▸ GAA P10253 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ ESR2 Q92731 1/20 0.38
▸ THRB P10828 1/20 0.38

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
SCHEMBL25186523 0.91 CYP3A4 (0.53) CYP3A4SKP2TSHRPNMTTAAR1
SCHEMBL2747648 0.88 SKP2 (0.65) CYP3A4SKP2TSHRPNMTTAAR1
SCHEMBL1170188 0.87 CYP3A4 (0.74) CYP3A4SKP2TSHRPNMTTAAR1
SCHEMBL7774089 0.85 SKP2 (0.56) CYP3A4SKP2ALDH1A1GLASMN1; SMN2
SCHEMBL11205585 0.85 SKP2 (0.56) CYP3A4SKP2ALDH1A1GLASMN1; SMN2
SCHEMBL3788823 0.83 TP53 (0.46) CYP3A4SKP2TSHRPNMTTAAR1
SCHEMBL10584299 0.83 CYP3A4 (0.68) CYP3A4SKP2TSHRPNMTTAAR1
SCHEMBL3793211 0.83 CYP3A4 (0.68) CYP3A4SKP2TSHRPNMTTAAR1
SCHEMBL2735049 0.81 TAAR1 (0.69) CYP3A4TSHRPNMTTAAR1ALDH1A1
SCHEMBL5604961 0.80 SKP2 (0.53) CYP3A4SKP2TSHRALDH1A1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114163838-B Supercritical CO 2 Yellow reactive disperse dye for dyeing and preparation method and application thereof 大连工业大学 2023-05-16 — — CN disclosed
CN-107817649-B Photosensitive resin composition, polyamide resin and method for producing same, compound and method for producing same, cured film and method for producing same 东京应化工业株式会社 2022-09-16 — — CN disclosed
CN-114163838-A Supercritical CO2Yellow reactive disperse dye for dyeing and preparation method and application thereof 大连工业大学 2022-03-11 — — CN disclosed
CN-101379111-B Polymerizable unsaturated compound and method for producing the same WAKO PURE CHEM IND LTD 2012-01-11 — — CN disclosed
US-7960567-B2 Compounds and methods useful for treating asthma and allergic inflammation AMGEN INC. (US) 2011-06-14 — — US disclosed
CN-101868444-A Acetylenic compound, salt thereof, condensate thereof, and composition thereof FUJIFILM CORP 2010-10-20 — — CN disclosed
CN-101808982-A Acetylene compound FUJIFILM CORP 2010-08-18 — — CN disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 — — US disclosed
CN-101379111-A Polymerizable unsaturated compound and method for producing the same WAKO PURE CHEM IND LTD (JP) 2009-03-04 — — CN disclosed
US-20080312270-A1 COMPOUNDS AND METHODS USEFUL FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION AMGEN INC. 2008-12-18 — — US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 — — EP disclosed
US-5081196-A Containing an acetylenically unsaturated monoamine compound UBE INDUSTRIES, LTD. (JP) 1992-01-14 — — US disclosed
EP-0357367-A2 Terminal-modified aromatic imide oligomer composition UBE INDUSTRIES, LTD. (JP) 1990-03-07 — — 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 (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-20080312270-A1 COMPOUNDS AND METHODS USEFUL FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION CCL11, LTC4S, TSLP CYP3A4 659/4885SKP2 3066/4885TSHR 4812/4885
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 CYP3A4 177/4885SKP2 2544/4885TSHR 1688/4885

“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.

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