Sugi Predict

Sugi Predict / Compounds / SCHEMBL3414799

SCHEMBL3414799

SCHEMBL3414799

C1=Cc2c(ccc3c2ccc2ccccc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPRT1 P00492 4/20 0.48
▸ ALDH1A1 P00352 4/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ PAX8 Q06710 1/20 0.37
▸ CYP1A2 P05177 3/20 0.37
▸ HIF1A Q16665 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ CYP2C9 P11712 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL30996901 1.00 HPRT1 (0.48) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL30329701 0.98 HPRT1 (0.47) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
Ethane SCHEMBL27321160 0.97 HPRT1 (0.45) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
Phenanthrene SCHEMBL28265186 0.93 ALDH1A1 (0.44) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL51496 0.91 ALDH1A1 (0.41) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL29490374 0.91 ALDH1A1 (0.41) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL5503788 0.91 ALDH1A1 (0.41) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL27514304 0.91 HPRT1 (0.40) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL30642055 0.89 ALDH1A1 (0.39) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
Charcoal, Activated SCHEMBL30949786 0.89 ALDH1A1 (0.39) HPRT1ALDH1A1HSD17B10TDP1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11825742-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-21 — — US claimed
US-20190267553-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-08-29 — — US claimed
CN-108795290-A Coating composition and coating and coating and silica coating and the method for having cated product and forming coating in substrate surface 广东美的厨房电器制造有限公司 2018-11-13 — — CN claimed
CN-108425104-A A kind of coating production using sulfhydryl compound as transition zone 江苏菲沃泰纳米科技有限公司 2018-08-21 — — CN claimed
CN-105330664-B A kind of synthetic method of Xi Gelieting impurity 合肥华方医药科技有限公司 2018-06-19 — — CN claimed
CN-108084866-A A kind of fluorine richness flexibility UV cures the preparation method of hyperbranched aqueous polyurethane coating material 江南大学 2018-05-29 — — CN claimed
CN-106279179-B A kind of krill DTDP extraction purification and detection method 山东师范大学 2018-03-23 — — CN claimed
CN-107787322-A Tricyclic compound and their purposes as phosphodiesterase inhibitors 辉瑞大药厂 2018-03-09 — — CN claimed
CN-107699868-A Preparation method of high-insulativity nano protective coating 江苏菲沃泰纳米科技有限公司 2018-02-16 — — CN claimed
CN-107587119-A A kind of preparation method of the high insulating rigid nano protecting coating of composite construction 无锡荣坚五金工具有限公司 2018-01-16 — — CN claimed
CN-103146291-A Ultraviolet light solidification gloss oil and preparation method thereof BOE TECHNOLOGY GROUP CO LTD 2013-06-12 — — CN claimed
CN-102898308-A Difluoroalkyl itaconate and its preparation method UNIV SOOCHOW 2013-01-30 — — CN claimed
CN-102757422-A Derivatives of N-[(1H-pyrazol-1-yl)aryl]-1H-indole or 1H- indazole-3-carboxamide and their therapeutic uses as p2y12 antagonists SANOFI SA 2012-10-31 — — CN claimed
CN-102333778-A Salt of tetrahydrotriazolopyridine derivative and crystal thereof EISAI R&D MAN CO LTD 2012-01-25 — — CN claimed
CN-102317243-A Cleaning compositions and methods HONEYWELL INT INC 2012-01-11 — — CN claimed
CN-102295560-A Difluoroalkyl maleate and preparation method thereof — 2011-12-28 — — CN claimed
CN-101863735-A Preparation method of 1, 1, 2, 2-tetrahydric perfluoro alkyl iodide ZHONGHUA INTERNAT SUZHOU NEW MATERIAL RES & DEV CO LTD 2010-10-20 — — CN claimed
CN-1780609-A Method for dispersing water-soluble or hydrophilic substances in a fluid under supercritical pressure ETHYPHARM SA (FR) 2006-05-31 — — CN claimed
CN-1121447-C Hydrophobic epoxide resin system VANDIK AG (CH) 2003-09-17 — — CN claimed
CN-1329642-A hydrophobic epoxy resin system VANDIK AG (CH) 2002-01-02 — — CN claimed

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-20190267553-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CYP1A1, CYP2E1, CYP1B1 HPRT1 527/4885ALDH1A1 13/4885HSD17B10 1262/4885
US-11825742-B2 Heterocyclic compound and organic light-emitting device including the same CYP1A1, CYP2E1, CYP1B1 HPRT1 527/4885ALDH1A1 13/4885HSD17B10 1262/4885

“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.