SCHEMBL14058913

SCHEMBL14058913

CCCCNc1ccc(I)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ SCN5A Q14524 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ MAOA P21397 1/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ DRD4 P21917 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ HRH2 P25021 1/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ HTR2C P28335 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ NTSR1 P30989 1/20 0.43
▸ HRH1 P35367 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ SCN1A P35498 1/20 0.43
▸ HTR2B P41595 1/20 0.43
▸ SCN7A Q01118 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.43

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
SCHEMBL28802324 0.92 ABL1 (0.51) MAPTALDH1A1ABL1KCNH3PRSS1
SCHEMBL22082127 0.92 ABL1 (0.51) MAPTALDH1A1ABL1KCNH3PRSS1
SCHEMBL27861311 0.92 ABL1 (0.51) MAPTALDH1A1ABL1KCNH3PRSS1
SCHEMBL181559 0.89 MAPT (0.52) MAPTLMNASCN5AALDH1A1CYP1A2
SCHEMBL8772822 0.86 MAPT (0.46) MAPTALDH1A1GAAARCA1
SCHEMBL13679674 0.86 LMNA (0.39) LMNASCN5AALDH1A1CYP1A2MAOA
SCHEMBL18627182 0.86 LMNA (0.51) LMNASCN5AALDH1A1CYP1A2MAOA
SCHEMBL30800856 0.82 MAPT (0.46) MAPTLMNASCN5AALDH1A1CYP1A2
SCHEMBL1241959 0.81 ABL1 (0.56) MAPTLMNASCN5AALDH1A1CYP1A2
SCHEMBL11528091 0.81 MAPT (0.55) MAPTALDH1A1CYP1A2SIGMAR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105906808-B One kind contains tertiary butyl and polynary aryl oxide structure soluble polyimide and preparation method thereof 上海交通大学 2018-07-03 — — CN claimed
CN-101531598-A Tert-butyl benzidine and preparation method thereof UNIV EAST CHINA SCIENCE & TECH 2009-09-16 — — CN claimed
CN-112175171-B Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 苏州希夫安材料科技有限公司 2022-07-05 — — CN disclosed
CN-112175171-A Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 南京优写智能科技有限公司 2021-01-05 — — CN disclosed
US-10370484-B2 Polymer compound and light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-08-06 — — US disclosed
CN-105906808-B One kind contains tertiary butyl and polynary aryl oxide structure soluble polyimide and preparation method thereof 上海交通大学 2018-07-03 — — CN disclosed
US-9346795-B2 Substituted sulfonamides useful as antiapoptotic Bcl inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-05-24 — — US disclosed
CN-105542163-A Soluble polyimide with tert-butyl, ether bond, and bisphenol A structure and preparation method thereof UNIV SHANGHAI JIAOTONG 2016-05-04 — — CN disclosed
CN-102448920-B Antiviral compounds and uses thereof ABBVIE (US) 2016-04-06 — — CN disclosed
CN-103732589-B Can be used as the sulphonamide of the replacement of anti-apoptotic BCL inhibitor BRISTOL-MYERS SQUIBB CO. (US) 2016-03-30 — — CN disclosed
EP-2714681-B1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-06-24 — — EP disclosed
CN-103910882-A High-Tg soluble polyimide and preparation method thereof UNIV SHANGHAI JIAOTONG 2014-07-09 — — CN disclosed
US-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-15 — — US disclosed
WO-2012162365-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-11-29 — — WO disclosed
CN-102448920-A Antiviral compounds and uses thereof ABBOTT LAB 2012-05-09 — — CN disclosed
CN-101531598-A Tert-butyl benzidine and preparation method thereof UNIV EAST CHINA SCIENCE & TECH 2009-09-16 — — CN 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-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BCL2, BAX, BCL2A1 MAPT 4608/4885LMNA 2227/4885SCN5A 1058/4885
US-10370484-B2 Polymer compound and light emitting device using the same ARL1, NMRAL1, RB1 MAPT 3248/4885LMNA 3572/4885SCN5A 4509/4885

“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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